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(+/-)-6-[1-(2-ALLYLOXY-6-METHYL-BENZYLOXY)-ETHYL]-PHENAZINE-1-CARBOXYLIC-ACID-ALLYLESTER
SpectraBase Compound ID D3a0HF1CaO6
InChI InChI=1S/2C29H26N2O5/c2*1-5-16-34-24-15-7-10-18(3)25(24)29(33)36-19(4)20-11-8-13-22-26(20)30-23-14-9-12-21(27(23)31-22)28(32)35-17-6-2/h2*5-15,19H,1-2,16-17H2,3-4H3
InChIKey GDGWBLVFVFITCC-UHFFFAOYSA-N
Mol Weight 965.07 g/mol
Molecular Formula C58H52N4O10
Exact Mass 964.368344 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9HcOuLFLmTJ
Name (+/-)-6-[1-(2-ALLYLOXY-6-METHYL-BENZYLOXY)-ETHYL]-PHENAZINE-1-CARBOXYLIC-ACID-ALLYLESTER
Compound Number 9
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C58H52N4O10
InChI InChI=1S/2C29H26N2O5/c2*1-5-16-34-24-15-7-10-18(3)25(24)29(33)36-19(4)20-11-8-13-22-26(20)30-23-14-9-12-21(27(23)31-22)28(32)35-17-6-2/h2*5-15,19H,1-2,16-17H2,3-4H3
InChIKey GDGWBLVFVFITCC-UHFFFAOYSA-N
Literature Reference Author J.B.LAURSEN,C.G.JORGENSEN,J.NIELSEN
Literature Reference Citation BIOORG.MED.CHEM.,11,723(2003)
Literature Reference DOI 10.1016/S0968-0896(02)00472-8
Molecular Weight 965.072 g/mol
Sample ID 38597
Solvent CDCl3